Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MMP8 | P22894 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | KDM4A | O75164 | 1/20 | 0.46 |
| ▸ | METAP2 | P50579 | 1/20 | 0.46 |
| ▸ | METAP1 | P53582 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | CTSC | P53634 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20834910 | 1.00 | TSHR (0.53) | TSHRMMP8POLBCYP2C9CYP2C19 | |
| SCHEMBL21012467 | 0.85 | MMP8 (0.65) | TSHRMMP8KMT2ACYP2D6SMN1; SMN2 | |
| SCHEMBL29889846 | 0.83 | TSHR (0.56) | TSHRMMP8CYP2C9CYP2C19KMT2A | |
| SCHEMBL28028170 | 0.81 | METAP2 (0.66) | TSHRMETAP2METAP1CTSC | |
| SCHEMBL28028169 | 0.81 | METAP2 (0.66) | TSHRMETAP2METAP1CTSC | |
| Hydrochloric Acid SCHEMBL3841230 | 0.80 | METAP2 (0.64) | TSHRMETAP2METAP1CTSC | |
| Hydrochloric Acid SCHEMBL21458088 | 0.80 | METAP2 (0.64) | TSHRMETAP2METAP1CTSC | |
| SCHEMBL20834866 | 0.80 | NPC1 (0.55) | TSHRMMP8POLBCYP2C9CYP2C19 | |
| SCHEMBL25415614 | 0.80 | MMP8 (0.55) | TSHRMMP8POLBCYP2C9CYP2C19 | |
| SCHEMBL3291656 | 0.79 | TSHR (0.51) | TSHRMMP8KMT2ASMN1; SMN2ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1636224-B1 | PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSHORYLASE | PROSIDION LTD (GB) | 2010-07-14 | — | — | EP | disclosed |
| EP-0910564-A1 | D-AMINO ACID DERIVED INHIBITORS OF CYSTEINE AND SERINE PROTEASES | CEPHALON, INC. (US) | 1999-04-28 | — | — | EP | disclosed |
| EP-0910564-A4 | — | — | 1999-04-28 | — | — | EP | disclosed |
| WO-1997021690-A1 | D-AMINO ACID DERIVED INHIBITORS OF CYSTEINE AND SERINE PROTEASES | CEPHALON, INC. (US) | 1997-06-19 | — | — | WO | disclosed |